(2R,3S,4R,5S)-2-methyl-6-[(2R,4S,5R,6R)-2-methyl-6-[(1S,2S,5'R,6R,7S,8R,9S,12S,13R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxy-5-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxyoxane-3,4,5-triol

Basic Information

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CAS Number

76296-74-7

Molecular Formula

C51H82O20

Molecular Weight

1015.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Polymers and Plastics Thermoplastics Polyolefins

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Physical State

Powder

Density

1.43

SMILES

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CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)OC7C(C(C(C(O7)C)OC8C(C(C(C(O8)C)O)O)O)OC9C(C(C(C(O9)C)O)O)O)OC2C(C(C(C(O2)CO)O)O)O)C)C)C)OC1

InChI

InChI=1S/C51H82O20/c1-20-10-15-51(62-19-20)21(2)32-30(71-51)17-29-27-9-8-25-16-26(11-13-49(25,6)28(27)12-14-50(29,32)7)66-48-44(70-46-39(59)37(57)35(55)31(18-52)67-46)40(60)42(24(5)65-48)68-47-41(61)43(34(54)23(4)64-47)69-45-38(58)36(56)33(53)22(3)63-45/h8,20-24,26-48,52-61H,9-19H2,1-7H3

InChIKey

MVTXRBHSDGYXLA-UHFFFAOYSA-N

Complexity

1900

Synonyms & References

English

76296-74-7
DTXSID50856574
PUBCHEM_71664512
HY-W019830
CS-0031621
Polyphyllin F
a-L-Mannopyranoside, (3b,25R)-spirost-5-en-3-ylO-6-deoxy-a-L-mannopyranosyl-(1&reg
4)]-O-[b-D-glucopyranosyl-(1&reg
O-6-Deoxy-alpha-L-mannopyranosyl-(1-3)-O-[6-deoxy-alpha-L-mannopyranosyl-(1-4)]-O-[beta-D-glucopyranosyl-(1-2)]-6-deoxy-alpha-L-mannopyranoside (3beta,25R)-spirost-5-en-3-yl

MDL Number

MFCD14155630

FAQ

What are the physical and chemical properties of (2R,3S,4R,5S)-2-methyl-6-[(2R,4S,5R,6R)-2-methyl-6-[(1S,2S,5'R,6R,7S,8R,9S,12S,13R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxy-5-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxyoxane-3,4,5-triol (CAS: 76296-74-7)?

The compound is a complex organic molecule with a high molecular weight due to its intricate structure. It is not particularly soluble in water but may have good solubility in organic solvents. Chemically, it is reactive, especially towards nucleophiles and electrophiles, and is stable under neutral conditions. Its crystalline form is not commonly discussed, but it is likely to form stable crystals under controlled conditions. The compound exhibits a unique reactivity profile, making it suitable for specific chemical transformations and reactions.

How is (2R,3S,4R,5S)-2-methyl-6-[(2R,4S,5R,6R)-2-methyl-6-[(1S,2S,5'R,6R,7S,8R,9S,12S,13R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxy-5-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxyoxane-3,4,5-triol (CAS: 76296-74-7) typically synthesized?

This compound is typically synthesized through multistep organic synthesis, involving the use of specific catalysts and reagents to form the complex spiro and oxane structures. The synthesis requires high selectivity and controlled reaction conditions to achieve the desired product. Common techniques include Mitsunobu reactions, oxime formation, and ring-closing metathesis. The overall yield is moderate, and the process involves several purification steps.

What industries use (2R,3S,4R,5S)-2-methyl-6-[(2R,4S,5R,6R)-2-methyl-6-[(1S,2S,5'R,6R,7S,8R,9S,12S,13R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxy-5-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxyoxane-3,4,5-triol (CAS: 76296-74-7)?

This compound is used in the pharmaceutical industry for the development of new drugs, particularly those requiring complex organic structures. In the polymer industry, it can serve as a monomer or functional additive. It may also be used in the production of sensors and semiconductors due to its unique electronic properties. The compound's specific applications depend on its availability and the ability to synthesize it in a controlled manner.

What precautions should be taken when handling (2R,3S,4R,5S)-2-methyl-6-[(2R,4S,5R,6R)-2-methyl-6-[(1S,2S,5'R,6R,7S,8R,9S,12S,13R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxy-5-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxyoxane-3,4,5-triol (CAS: 76296-74-7)?

Proper handling of this compound requires the use of personal protective equipment (PPE) such as gloves, goggles, and a lab coat. It should be stored in a well-ventilated area, preferably under a fume hood, to minimize exposure to air. Spills should be cleaned up promptly using appropriate absorbents, and the area should be well-ventilated. Safety data sheets (SDS) should be consulted for specific handling and disposal instructions. This compound should be handled with care due to its reactivity and potential health risks.